2-[(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide

Formula:C18H10N3O5ClF2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide is a drug-like molecule.

MolName	2-[(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide
MolecularFormula	C18H10N3O5ClF2S
Smiles	[O-][N+](c(cc1)cc(/C=C(/C(N2CC(Nc(ccc(F)c3)c3F)=O)=O)\SC2=O)c1Cl)=O
InChI	InChI=1S/C18H10ClF2N3O5S/c19-12-3-2-11(24(28)29)5-9(12)6-15-17(26)23(18(27)30-15)8-16(25)22-14-4-1-10(20)7-13(14)21/h1-7H,8H2,(H,22,25)
InChIK	OLKTYLHZOLSIQJ-UHFFFAOYSA-N
TotalMolweight	453.808
Molweight	453.808
MonoisotopicMass	452.999775
CLogP	2.4207
CLogS	-5.885
H Acceptors	8
H Donors	1
TotalSurfaceArea	302.28
Relative PSA	0.33757
PolarSurfaceArea	137.6
Druglikeness	-1.1815
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; limit! methylene-thiazolidine-2,4-dione
Shape Index	0.56667
Fragments	1
Non HAtoms	30
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-[(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide | 2 - 2-[(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,4-difluorophenyl)acetamide

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